Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "320d428c028c8406f66f74c55c5a2a4d",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 43.673,
"b": 39.401,
"c": 72.385,
"alpha": 90.000,
"beta": 97.383,
"gamma": 90.000
},
"wavelengths": [0.97930],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [19.7,1.65],
"number_observations_unique": 25923,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.1
},
{
"type": "R(pim)",
"value": 0.077
},
{
"type": "I/SigI",
"value": 8.4
},
{
"type": "Completeness",
"value": 87.3
},
{
"type": "Redundancy",
"value": 2.5
},
{
"type": "CC(1/2)",
"value": 0.993
}
]
},
"refln_shells": [
{
"resolution_limits": [1.68,1.65],
"number_observations_unique": 994,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.75
},
{
"type": "R(pim)",
"value": 0.55
},
{
"type": "I/SigI",
"value": 2
},
{
"type": "CC(1/2)",
"value": 0.485
}
]
}
]
}